SCHEMBL5115463

SCHEMBL5115463

CC(C)Oc1ccc(CCCOc2cc(CCC(=O)O)n(-c3ccccc3)n2)c(Oc2ncc(Cl)cc2Cl)c1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARG P37231 12/20 0.46
L3MBTL1 Q9Y468 1/20 0.40
LIPE Q05469 1/20 0.39
PPARD Q03181 3/20 0.38
PPARA Q07869 3/20 0.38
FABP3 P05413 2/20 0.37
SNCA P37840 1/20 0.37
FABP4 P15090 2/20 0.36
ACACB O00763 1/20 0.36
PTGDR Q13258 2/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5119989 0.90 PPARG (0.56) PPARGLIPE
SCHEMBL5120850 0.90 PPARG (0.47) PPARGL3MBTL1LIPEPPARDPPARA
SCHEMBL5120546 0.88 PPARG (0.55) PPARGLIPE
SCHEMBL5105830 0.87 PPARG (0.52) PPARGPPARDPPARAFABP3FABP4
SCHEMBL5120724 0.82 PPARG (0.42) PPARGLIPEPPARDPPARA
SCHEMBL5120057 0.81 PPARG (0.51) PPARGPPARDPPARAFABP3SNCA
SCHEMBL5121618 0.81 PPARG (0.60) PPARG
SCHEMBL5113591 0.80 PPARG (0.55) PPARGLIPE
SCHEMBL5120220 0.80 PPARG (0.58) PPARG
SCHEMBL5113212 0.80 PPARG (0.57) PPARG

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080051418-A1 Arylalkanoic Acid Derivative TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-02-28 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080051418-A1 Arylalkanoic Acid Derivative INSR, NPY1R, GPR119 PPARG 52/4885L3MBTL1 2694/4885LIPE 2122/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.